SCHEMBL30173751

SCHEMBL30173751

Cc1cc(C)cc(CCCOS(C)(=O)=O)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MMP9 P14780 1/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33
FUT7 Q11130 1/20 0.32
FFAR4 Q5NUL3 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23782510 0.89 MMP9 (0.43) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL5761353 0.83 TAAR1 (0.47) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL2453322 0.81 ALDH1A1 (0.50) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL15262553 0.81 ALDH1A1 (0.45) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL16395010 0.80 CA2 (0.50) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL228874 0.79 ALDH1A1 (0.47) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL26316551 0.76 ALDH1A1 (0.54) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL4399117 0.76 KDM4E (0.54) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL15464436 0.76 ALDH1A1 (0.48) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL5219832 0.76 TSHR (0.44) KDM4EUSP2ALDH1A1LMNAMMP9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115515685-A EIF4E inhibitor and application thereof 皮克医疗公司 2022-12-23 CN disclosed